[5-[[furan-2-ylmethyl(phenylcarbonyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate

Systemtic Name: [5-[[furan-2-ylmethyl(phenylcarbonyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate Openeye Name: [5-[[benzoyl(2-furylmethyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-[[benzoyl(2-furanylmethyl)amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[benzoyl(furan-2-ylmethyl)amino]methyl]-2-methoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-[[benzoyl(2-furfuryl)amino]methyl]-2-methoxy-phenyl] ester Formula: C21H21NO6S MolecularWeight: 415.45954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CC2=CC=CO2)C(=O)C3=CC=CC=C3)OS(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CC2=CC=CO2)C(=O)C3=CC=CC=C3)OS(=O)(=O)C

InChI

InChI=1S/C21H21NO6S/c1-26-19-11-10-16(13-20(19)28-29(2,24)25)14-22(15-18-9-6-12-27-18)21(23)17-7-4-3-5-8-17/h3-13H,14-15H2,1-2H3